N-(4-benzyl-1-propan-2-ylpiperidin-4-yl)acetamide

C17H26N2O — CID 134505417

IUPACN-(4-benzyl-1-propan-2-ylpiperidin-4-yl)acetamide
SMILESCC(=O)NC1(Cc2ccccc2)CCN(C(C)C)CC1
InChIInChI=1S/C17H26N2O/c1-14(2)19-11-9-17(10-12-19,18-15(3)20)13-16-7-5-4-6-8-16/h4-8,14H,9-13H2,1-3H3,(H,18,20)
InChIKeyNJAFLUULUIPQTH-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.61
Rot. Bonds4

About N-(4-benzyl-1-propan-2-ylpiperidin-4-yl)acetamide

N-(4-benzyl-1-propan-2-ylpiperidin-4-yl)acetamide (PubChem CID 134505417) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-(4-benzyl-1-propan-2-ylpiperidin-4-yl)acetamide.

Molecular Properties

Compound NameN-(4-benzyl-1-propan-2-ylpiperidin-4-yl)acetamide
PubChem CID134505417
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-(4-benzyl-1-propan-2-ylpiperidin-4-yl)acetamide
SMILESCC(=O)NC1(Cc2ccccc2)CCN(C(C)C)CC1
InChIInChI=1S/C17H26N2O/c1-14(2)19-11-9-17(10-12-19,18-15(3)20)13-16-7-5-4-6-8-16/h4-8,14H,9-13H2,1-3H3,(H,18,20)
InChIKeyNJAFLUULUIPQTH-UHFFFAOYSA-N
XLogP2.61
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-benzyl-1-methylpiperidin-4-yl)acetamide;ethane
CID 142327017
(4-acetamido-4-benzylpiperidin-1-yl) 4-methylbenzenesulfonate
CID 57108329
N-benzyl-4-methyl-1-propan-2-ylpiperidine-4-carboxamide
CID 139362651
[4-(benzylamino)-1-propan-2-ylazepan-4-yl]methanol
CID 65077679
4-acetamido-1-propan-2-ylpiperidine-4-carboxylic acid
CID 63702401
N-(1-benzylcyclopropyl)prop-2-enamide
CID 146108145
N-[(3-acetamido-1-benzylpyrrolidin-3-yl)methyl]acetamide
CID 126807065
4-(benzylamino)-1-propan-2-ylazepane-4-carboxylic acid
CID 65075754
2-amino-3-methyl-N-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butanamide
CID 142327146
(1-benzylcyclopentyl)urea
CID 86790395
4-(benzylamino)-1-propan-2-ylazepane-4-carboxamide
CID 65075738
3-(hydroxymethyl)-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)benzamide
CID 134505589

Frequently Asked Questions

What is the IUPAC name of N-(4-benzyl-1-propan-2-ylpiperidin-4-yl)acetamide?
The IUPAC name of N-(4-benzyl-1-propan-2-ylpiperidin-4-yl)acetamide (CID 134505417) is N-(4-benzyl-1-propan-2-ylpiperidin-4-yl)acetamide.
What is the SMILES notation for N-(4-benzyl-1-propan-2-ylpiperidin-4-yl)acetamide?
The canonical SMILES for N-(4-benzyl-1-propan-2-ylpiperidin-4-yl)acetamide is CC(=O)NC1(Cc2ccccc2)CCN(C(C)C)CC1.
What is the InChIKey of N-(4-benzyl-1-propan-2-ylpiperidin-4-yl)acetamide?
The InChIKey is NJAFLUULUIPQTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-14(2)19-11-9-17(10-12-19,18-15(3)20)13-16-7-5-4-6-8-16/h4-8,14H,9-13H2,1-3H3,(H,18,20).
What are the key properties of N-(4-benzyl-1-propan-2-ylpiperidin-4-yl)acetamide?
N-(4-benzyl-1-propan-2-ylpiperidin-4-yl)acetamide has a molecular weight of 274.41 g/mol, XLogP of 2.61, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-benzyl-1-propan-2-ylpiperidin-4-yl)acetamide is sourced from PubChem (CID 134505417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).